IFLAB-ZINC02685786 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 38 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.6990 1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0780 1.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.7760 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0780 -1.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6810 -1.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0210 -3.0050 -2.1980 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0430 -4.2080 -1.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -4.1220 -0.3140 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0720 -4.8660 0.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -5.7100 -2.5980 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0300 -5.0470 -4.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 -6.1840 -5.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0570 -6.7940 -5.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6180 -7.7680 -6.6320 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2730 -8.6790 -7.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5840 -9.5470 -8.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8210 -9.5250 -8.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4860 -8.6230 -7.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7520 -7.7220 -6.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1240 -6.7540 -5.7960 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1560 2.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6130 2.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1340 -2.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8700 -4.4480 -4.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9100 -4.4230 -4.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0860 -6.5580 -5.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3520 -8.7050 -7.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1140 -10.2630 -8.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3700 -10.2220 -8.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5660 -8.5970 -7.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 5 6 2 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 28 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 29 1 0 0 0 0 13 30 1 0 0 0 0 14 15 2 0 0 0 0 14 22 1 0 0 0 0 15 16 1 0 0 0 0 15 31 1 0 0 0 0 16 17 1 0 0 0 0 16 21 1 0 0 0 0 17 18 2 0 0 0 0 17 32 1 0 0 0 0 18 19 1 0 0 0 0 18 33 1 0 0 0 0 19 20 2 0 0 0 0 19 34 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 21 22 2 0 0 0 0 M END